Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IL1B | P01584 | 6/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 2/20 | 0.33 |
| ▸ | PHF8 | Q9UPP1 | 1/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | KDM5A | P29375 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL12289890 | 0.92 | IL1B (0.34) | IL1BNLRP3NPC1USP2TP53 | |
| SCHEMBL12286732 | 0.85 | IL1B (0.36) | IL1BNLRP3NPC1USP2TP53 | |
| SCHEMBL2562880 | 0.83 | SMN1; SMN2 (0.40) | IL1BNPC1USP2TP53RAB9A | |
| SCHEMBL12289888 | 0.82 | CYP11B1 (0.38) | IL1BNLRP3KDM4AKDM5AKDM4C | |
| SCHEMBL21170475 | 0.81 | IL1B (0.35) | IL1BCYP2A6PTGESNPC1RAB9A | |
| SCHEMBL21170229 | 0.74 | IL1B (0.37) | IL1BNLRP3PHF8KDM4AKDM5A | |
| SCHEMBL12289883 | 0.74 | KDM4A (0.39) | IL1BNLRP3KDM4AKDM5AKDM4C | |
| SCHEMBL21170176 | 0.73 | IL1B (0.34) | IL1BNLRP3NPC1USP2TP53 | |
| SCHEMBL2563223 | 0.71 | NPY5R (0.38) | IL1BNPC1RAB9A | |
| SCHEMBL21170103 | 0.69 | NPC1 (0.38) | IL1BNPC1USP2TP53RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3127541-B1 | CERTAIN AMINO-PYRIDAZINES, COMPOSITIONS THEREOF, AND METHODS OF THEIR USE | CYTOKINETICS INC (US) | 2019-07-17 | — | — | EP | disclosed |